3-methyl-5-sulfinooxy-benzenesulfonic acid

Systemtic Name: 3-methyl-5-sulfinooxy-benzenesulfonic acid Openeye Name: 3-methyl-5-sulfinooxy-benzenesulfonic acid CAS Name: 3-methyl-5-sulfinooxybenzenesulfonic acid IUPAC Name: 3-methyl-5-sulfinooxybenzenesulfonic acid Traditional Name: 3-methyl-5-sulfinooxy-besylic acid Formula: C7H8O6S2 MolecularWeight: 252.26482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)S(=O)(=O)O)OS(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1)S(=O)(=O)O)OS(=O)O

InChI

InChI=1S/C7H8O6S2/c1-5-2-6(13-14(8)9)4-7(3-5)15(10,11)12/h2-4H,1H3,(H,8,9)(H,10,11,12)